N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide

C85H107Cl3F3N9O9 — CID 157101806

About N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide

N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide (PubChem CID 157101806) has the molecular formula C85H107Cl3F3N9O9 and a molecular weight of 1562.20 g/mol. Its IUPAC name is N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide.

Molecular Properties

• Compound Name: N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide
• PubChem CID: 157101806
• Molecular Formula: C85H107Cl3F3N9O9
• Molecular Weight: 1562.20 g/mol
• Exact Mass: 1559.72
• IUPAC Name: N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide
• SMILES: CCN(CC)CCOc1cccc(C)c1C(=O)Nc1ccc(Cl)c(C)c1.CCOc1cccc(OCCN(C)C)c1C(=O)NCc1ccc(C)c(C(F)(F)F)c1.Cc1cc(NC(=O)c2c(C)cccc2OCCCN(C)C)ccc1Cl.Cc1cc(NC(=O)c2c(C)cccc2OCCN2CCN(C)CC2)ccc1Cl
• InChI: InChI=1S/C22H28ClN3O2.C22H27F3N2O3.C21H27ClN2O2.C20H25ClN2O2/c1-16-5-4-6-20(28-14-13-26-11-9-25(3)10-12-26)21(16)22(27)24-18-7-8-19(23)17(2)15-18;1-5-29-18-7-6-8-19(30-12-11-27(3)4)20(18)21(28)26-14-16-10-9-15(2)17(13-16)22(23,24)25;1-5-24(6-2)12-13-26-19-9-7-8-15(3)20(19)21(25)23-17-10-11-18(22)16(4)14-17;1-14-7-5-8-18(25-12-6-11-23(3)4)19(14)20(24)22-16-9-10-17(21)15(2)13-16/h4-8,15H,9-14H2,1-3H3,(H,24,27);6-10,13H,5,11-12,14H2,1-4H3,(H,26,28);7-11,14H,5-6,12-13H2,1-4H3,(H,23,25);5,7-10,13H,6,11-12H2,1-4H3,(H,22,24)
• InChIKey: AFVQWEFVFHEZQX-UHFFFAOYSA-N
• XLogP: 17.59
• TPSA: 178.75 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 14
• Rotatable Bonds: 30
• Heavy Atoms: 109
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1562.20
LogP ≤ 5	17.59
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide?

The IUPAC name of N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide (CID 157101806) is N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide.

What is the SMILES notation for N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide?

The canonical SMILES for N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide is CCN(CC)CCOc1cccc(C)c1C(=O)Nc1ccc(Cl)c(C)c1.CCOc1cccc(OCCN(C)C)c1C(=O)NCc1ccc(C)c(C(F)(F)F)c1.Cc1cc(NC(=O)c2c(C)cccc2OCCCN(C)C)ccc1Cl.Cc1cc(NC(=O)c2c(C)cccc2OCCN2CCN(C)CC2)ccc1Cl.

What is the InChIKey of N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide?

The InChIKey is AFVQWEFVFHEZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28ClN3O2.C22H27F3N2O3.C21H27ClN2O2.C20H25ClN2O2/c1-16-5-4-6-20(28-14-13-26-11-9-25(3)10-12-26)21(16)22(27)24-18-7-8-19(23)17(2)15-18;1-5-29-18-7-6-8-19(30-12-11-27(3)4)20(18)21(28)26-14-16-10-9-15(2)17(13-16)22(23,24)25;1-5-24(6-2)12-13-26-19-9-7-8-15(3)20(19)21(25)23-17-10-11-18(22)16(4)14-17;1-14-7-5-8-18(25-12-6-11-23(3)4)19(14)20(24)22-16-9-10-17(21)15(2)13-16/h4-8,15H,9-14H2,1-3H3,(H,24,27);6-10,13H,5,11-12,14H2,1-4H3,(H,26,28);7-11,14H,5-6,12-13H2,1-4H3,(H,23,25);5,7-10,13H,6,11-12H2,1-4H3,(H,22,24).

What are the key properties of N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide?

N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide has a molecular weight of 1562.20 g/mol, XLogP of 17.59, 30 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 157101806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).